Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ujd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ GLU 6.A OE1 no hydrogen 3.538 N/A LYS 2.A NZ GLU 6.A OE2 no hydrogen 2.747 N/A LYS 2.A NZ SER 79.A OG.A no hydrogen 3.298 N/A LEU 5.A N ASP 1.A O no hydrogen 2.996 N/A GLU 6.A N LYS 2.A O no hydrogen 2.940 N/A ASN 7.A N THR 3.A O no hydrogen 2.961 N/A ASN 8.A N LEU 5.A O no hydrogen 3.479 N/A GLN 9.A NE2 TYR 18.A OH no hydrogen 3.134 N/A GLN 9.A NE2 TYR 172.A OH no hydrogen 3.002 N/A PHE 10.A N LEU 5.A O no hydrogen 2.816 N/A GLY 14.A N THR 11.A OG1 no hydrogen 3.015 N/A VAL 15.A N THR 11.A O no hydrogen 2.913 N/A LYS 16.A N ASP 12.A O no hydrogen 3.073 N/A VAL 17.A N GLU 13.A O no hydrogen 2.870 N/A TYR 18.A N GLY 14.A O no hydrogen 3.029 N/A GLU 19.A N VAL 15.A O no hydrogen 2.885 N/A PHE 20.A N LYS 16.A O no hydrogen 3.015 N/A ILE 21.A N VAL 17.A O no hydrogen 3.440 N/A ILE 21.A N TYR 18.A O no hydrogen 3.202 N/A PHE 22.A N TYR 18.A O no hydrogen 2.866 N/A GLY 23.A N GLU 19.A O no hydrogen 2.895 N/A ASN 25.A N GLU 19.A OE2 no hydrogen 2.814 N/A TYR 26.A N GLY 23.A O no hydrogen 2.947 N/A SER 28.A OG.B ARG 118.A O no hydrogen 3.567 N/A SER 29.A N ASP 119.A OD2 no hydrogen 2.953 N/A SER 29.A OG ASP 119.A OD2 no hydrogen 2.746 N/A GLY 30.A N GLU 208.A OE2 no hydrogen 2.892 N/A GLY 31.A N SER 28.A O no hydrogen 3.151 N/A ALA 34.A N GLY 30.A O no hydrogen 3.084 N/A THR 35.A N GLY 31.A O no hydrogen 3.208 N/A THR 35.A OG1 GLY 31.A O no hydrogen 2.918 N/A LYS 36.A N LEU 32.A O no hydrogen 2.950 N/A LYS 36.A NZ GLU 33.A OE2 no hydrogen 3.491 N/A LYS 37.A N GLU 33.A O no hydrogen 3.175 N/A ILE 38.A N ALA 34.A O no hydrogen 2.834 N/A LEU 39.A N THR 35.A O no hydrogen 3.118 N/A SER 40.A N LYS 37.A O no hydrogen 3.151 N/A SER 40.A OG.A LYS 37.A O no hydrogen 2.731 N/A ILE 42.A N LEU 39.A O no hydrogen 3.077 N/A ASN 45.A N SER 48.A OG no hydrogen 2.902 N/A GLU 46.A N GLU 46.A OE1 no hydrogen 2.759 N/A ASN 47.A N ASN 45.A OD1 no hydrogen 2.876 N/A SER 48.A N ASN 45.A O no hydrogen 2.979 N/A SER 48.A OG ASN 45.A O no hydrogen 3.292 N/A SER 48.A OG ASN 45.A OD1 no hydrogen 3.546 N/A LYS 49.A N ASP 113.A OD2 no hydrogen 2.769 N/A VAL 50.A N HIS 71.A O no hydrogen 2.821 N/A LEU 51.A N LEU 114.A O no hydrogen 2.968 N/A ASP 52.A N HIS 73.A O no hydrogen 2.881 N/A ILE 53.A N TYR 116.A O no hydrogen 2.849 N/A GLY 54.A N ILE 75.A O no hydrogen 2.743 N/A SER 55.A N ILE 75.A O no hydrogen 3.166 N/A GLY 56.A N ASP 76.A OD2 no hydrogen 2.908 N/A GLY 58.A N SER 55.A O no hydrogen 2.959 N/A GLY 59.A N ASN 25.A O no hydrogen 2.918 N/A CYS 61.A SG ASP 52.A OD2 no hydrogen 3.686 N/A MET 62.A N GLY 58.A O no hydrogen 2.916 N/A TYR 63.A N GLY 59.A O no hydrogen 2.919 N/A ILE 64.A N GLY 60.A O no hydrogen 2.960 N/A ASN 65.A N CYS 61.A O no hydrogen 2.916 N/A ASN 65.A ND2 ALA 70.A O no hydrogen 2.916 N/A GLU 66.A N MET 62.A O no hydrogen 2.903 N/A LYS 67.A N TYR 63.A O no hydrogen 2.811 N/A LYS 67.A NZ LEU 39.A O no hydrogen 3.012 N/A LYS 67.A NZ TYR 68.A OH no hydrogen 2.973 N/A TYR 68.A N ILE 64.A O no hydrogen 2.996 N/A TYR 68.A OH ILE 42.A O no hydrogen 2.698 N/A GLY 69.A N ASN 65.A O no hydrogen 2.753 N/A HIS 71.A N SER 48.A O no hydrogen 2.979 N/A HIS 71.A ND1.A SER 48.A O no hydrogen 2.940 N/A THR 72.A N LYS 94.A O no hydrogen 2.796 N/A THR 72.A OG1.A LYS 94.A O no hydrogen 3.403 N/A HIS 73.A N VAL 50.A O no hydrogen 2.928 N/A HIS 73.A NE2 GLU 98.A OE1 no hydrogen 2.795 N/A GLY 74.A N ILE 96.A O no hydrogen 2.766 N/A ILE 75.A N ASP 52.A O no hydrogen 2.925 N/A ASP 76.A N GLU 98.A O no hydrogen 3.096 N/A CYS 78.A N ASP 76.A OD1 no hydrogen 3.103 N/A SER 79.A N GLU 6.A OE2 no hydrogen 2.935 N/A SER 79.A OG.B GLU 6.A OE2 no hydrogen 3.005 N/A ASN 80.A ND2 PHE 10.A O no hydrogen 2.878 N/A ASN 80.A ND2 ASP 12.A OD1 no hydrogen 2.940 N/A VAL 82.A N CYS 78.A O no hydrogen 3.171 N/A ASN 83.A N SER 79.A O no hydrogen 2.935 N/A MET 84.A N ASN 80.A O no hydrogen 3.043 N/A ALA 85.A N ILE 81.A O no hydrogen 2.861 N/A ASN 86.A N VAL 82.A O no hydrogen 2.918 N/A ASN 86.A ND2 PHE 97.A O no hydrogen 3.671 N/A GLU 87.A N ASN 83.A O no hydrogen 3.243 N/A GLU 87.A N MET 84.A O no hydrogen 3.088 N/A ARG 88.A N ALA 85.A O no hydrogen 3.063 N/A ARG 88.A NH1 GLU 19.A OE2 no hydrogen 2.670 N/A ARG 88.A NH1 ASN 25.A OD1 no hydrogen 2.898 N/A ARG 88.A NH2 GLU 19.A OE1 no hydrogen 3.091 N/A ARG 88.A NH2 GLU 19.A OE2 no hydrogen 3.473 N/A ASN 92.A ND2 ASN 65.A OD1 no hydrogen 2.926 N/A LYS 94.A N ASN 92.A OD1 no hydrogen 2.957 N/A LYS 94.A NZ GLU 46.A O no hydrogen 2.841 N/A LYS 94.A NZ GLY 69.A O no hydrogen 2.827 N/A ILE 95.A N ASN 92.A O no hydrogen 3.415 N/A ILE 96.A N THR 72.A O no hydrogen 2.928 N/A GLU 98.A N GLY 74.A O no hydrogen 2.856 N/A ASN 100.A N ASP 76.A O no hydrogen 3.073 N/A ASN 100.A ND2 GLU 98.A OE2 no hydrogen 2.901 N/A ASP 101.A N ASN 100.A OD1 no hydrogen 2.822 N/A LEU 103.A N ASP 101.A OD1 no hydrogen 2.987 N/A THR 104.A N ASP 101.A O no hydrogen 2.954 N/A THR 104.A OG1 ASP 101.A O no hydrogen 3.186 N/A LYS 105.A N ASP 101.A O no hydrogen 2.973 N/A LYS 105.A NZ GLU 98.A OE1 no hydrogen 2.994 N/A LYS 105.A NZ GLU 98.A OE2 no hydrogen 2.755 N/A ASN 110.A N LYS 138.A O no hydrogen 2.883 N/A ASN 111.A N TRP 139.A O no hydrogen 2.713 N/A PHE 112.A N TRP 139.A O no hydrogen 2.949 N/A ASP 113.A N LYS 49.A O no hydrogen 2.796 N/A LEU 114.A N LYS 49.A O no hydrogen 3.362 N/A ILE 115.A N THR 145.A O no hydrogen 2.967 N/A TYR 116.A N LEU 51.A O no hydrogen 2.796 N/A SER 117.A N LEU 147.A O no hydrogen 3.007 N/A SER 117.A OG ILE 53.A O no hydrogen 2.779 N/A ARG 118.A NE THR 149.A OG1 no hydrogen 2.743 N/A ARG 118.A NH1 TYR 116.A OH no hydrogen 3.547 N/A ARG 118.A NH2 SER 29.A O no hydrogen 2.995 N/A ASP 119.A N THR 149.A O no hydrogen 2.874 N/A LEU 122.A N ASP 150.A OD1 no hydrogen 3.113 N/A LEU 124.A N ILE 121.A O no hydrogen 2.928 N/A ASN 128.A N SER 125.A OG no hydrogen 3.149 N/A LYS 129.A N SER 125.A O no hydrogen 2.802 N/A LYS 129.A NZ ILE 121.A O no hydrogen 3.101 N/A LYS 129.A NZ LEU 124.A O no hydrogen 2.854 N/A LYS 129.A NZ THR 173.A O no hydrogen 2.854 N/A ASN 130.A N LEU 126.A O no hydrogen 3.200 N/A LYS 131.A N GLU 127.A O no hydrogen 3.167 N/A LYS 131.A NZ GLU 127.A OE2 no hydrogen 3.135 N/A LEU 132.A N ASN 128.A O no hydrogen 2.852 N/A PHE 133.A N LYS 129.A O no hydrogen 3.005 N/A GLN 134.A N ASN 130.A O no hydrogen 3.044 N/A LYS 135.A N LYS 131.A O no hydrogen 3.171 N/A LYS 135.A NZ LEU 103.A O no hydrogen 3.437 N/A CYS 136.A N LEU 132.A O no hydrogen 2.857 N/A CYS 136.A SG LEU 132.A O no hydrogen 3.462 N/A TYR 137.A N PHE 133.A O no hydrogen 2.930 N/A LYS 138.A N GLN 134.A O no hydrogen 3.268 N/A TRP 139.A N LYS 135.A O no hydrogen 2.899 N/A LEU 140.A N CYS 136.A O no hydrogen 3.023 N/A LYS 141.A N PHE 112.A O no hydrogen 2.832 N/A LYS 141.A NZ ASP 113.A OD1 no hydrogen 3.265 N/A LYS 141.A NZ ASP 113.A OD2 no hydrogen 3.061 N/A GLY 144.A N LYS 141.A O no hydrogen 2.804 N/A THR 145.A N ASP 113.A O no hydrogen 2.960 N/A LEU 146.A N ALA 254.A O no hydrogen 2.822 N/A LEU 147.A N ILE 115.A O no hydrogen 2.864 N/A ILE 148.A N PHE 252.A O no hydrogen 2.847 N/A THR 149.A N SER 117.A O no hydrogen 2.942 N/A THR 149.A OG1 ASP 119.A OD1 no hydrogen 2.815 N/A ASP 150.A N GLY 250.A O no hydrogen 2.946 N/A TYR 151.A N ASP 150.A OD1 no hydrogen 3.004 N/A CYS 152.A N ARG 248.A O no hydrogen 2.856 N/A CYS 152.A SG ASP 150.A O no hydrogen 3.781 N/A ALA 153.A N ILE 175.A O no hydrogen 3.006 N/A THR 154.A N MET 246.A O no hydrogen 2.982 N/A THR 154.A OG1 GLU 155.A OE1 no hydrogen 3.246 N/A GLU 155.A N GLU 155.A OE1 no hydrogen 2.649 N/A ASN 158.A N GLU 155.A O no hydrogen 2.913 N/A ASN 158.A ND2 THR 154.A OG1 no hydrogen 3.024 N/A TRP 159.A N LYS 156.A O no hydrogen 3.113 N/A TRP 159.A NE1 THR 154.A O no hydrogen 2.849 N/A PHE 163.A N ASP 160.A OD1 no hydrogen 3.017 N/A LYS 164.A N ASP 160.A O no hydrogen 2.903 N/A GLU 165.A N ASP 161.A O no hydrogen 3.008 N/A TYR 166.A N GLU 162.A O no hydrogen 3.058 N/A VAL 167.A N PHE 163.A O no hydrogen 2.982 N/A LYS 168.A N LYS 164.A O no hydrogen 2.956 N/A GLN 169.A N GLU 165.A O no hydrogen 2.863 N/A ARG 170.A N TYR 166.A O no hydrogen 2.984 N/A ARG 170.A NH1 GLN 169.A OE1 no hydrogen 2.844 N/A LYS 171.A N LYS 168.A O no hydrogen 3.192 N/A TYR 172.A N VAL 167.A O no hydrogen 3.246 N/A THR 173.A N LEU 122.A O no hydrogen 2.913 N/A GLU 179.A N THR 176.A OG1 no hydrogen 2.945 N/A TYR 180.A N THR 176.A O no hydrogen 3.068 N/A TYR 180.A OH ASP 150.A OD2 no hydrogen 2.775 N/A ALA 181.A N VAL 177.A O no hydrogen 3.047 N/A ASP 182.A N GLU 178.A O no hydrogen 3.036 N/A ILE 183.A N GLU 179.A O no hydrogen 3.087 N/A LEU 184.A N TYR 180.A O no hydrogen 3.203 N/A THR 185.A N ALA 181.A O no hydrogen 2.996 N/A THR 185.A OG1.A ALA 181.A O no hydrogen 3.099 N/A THR 185.A OG1.B ALA 181.A O no hydrogen 3.319 N/A THR 185.A OG1.B ASP 182.A O no hydrogen 2.758 N/A ALA 186.A N ASP 182.A O no hydrogen 2.895 N/A CYS 187.A N ILE 183.A O no hydrogen 2.967 N/A CYS 187.A N LEU 184.A O no hydrogen 3.201 N/A CYS 187.A SG ASN 130.A O no hydrogen 3.923 N/A CYS 187.A SG ASN 130.A OD1 no hydrogen 3.327 N/A CYS 187.A SG ILE 183.A O no hydrogen 3.454 N/A ASN 188.A N THR 185.A O no hydrogen 2.986 N/A ASN 188.A ND2 TYR 137.A OH no hydrogen 3.071 N/A PHE 189.A N LEU 184.A O no hydrogen 3.187 N/A LYS 190.A N THR 255.A O no hydrogen 2.778 N/A LYS 190.A NZ ASN 188.A O no hydrogen 3.050 N/A ASN 191.A ND2 THR 255.A OG1 no hydrogen 2.908 N/A VAL 193.A N LYS 253.A O no hydrogen 2.822 N/A LYS 195.A N TYR 251.A O no hydrogen 2.848 N/A LEU 197.A N TRP 249.A O no hydrogen 2.789 N/A SER 198.A N ASP 196.A OD1 no hydrogen 3.018 N/A SER 198.A OG ASP 196.A OD1 no hydrogen 2.570 N/A TRP 201.A N LEU 197.A O no hydrogen 2.839 N/A TRP 201.A NE1 SER 29.A OG no hydrogen 3.002 N/A ASN 202.A N SER 198.A O no hydrogen 2.839 N/A ASN 202.A ND2 SER 242.A OG no hydrogen 2.920 N/A GLN 203.A N ASP 199.A O no hydrogen 3.023 N/A LEU 204.A N TYR 200.A O no hydrogen 2.927 N/A LEU 205.A N TRP 201.A O no hydrogen 2.824 N/A GLU 206.A N ASN 202.A O no hydrogen 2.958 N/A VAL 207.A N GLN 203.A O no hydrogen 3.107 N/A GLU 208.A N LEU 204.A O no hydrogen 3.042 N/A HIS 209.A N LEU 205.A O no hydrogen 2.799 N/A HIS 209.A NE2 ASP 232.A OD1 no hydrogen 2.682 N/A LYS 210.A N GLU 206.A O no hydrogen 2.931 N/A TYR 211.A N VAL 207.A O no hydrogen 2.965 N/A LEU 212.A N GLU 208.A O no hydrogen 2.972 N/A HIS 213.A N HIS 209.A O no hydrogen 3.081 N/A HIS 213.A NE2 ASP 232.A OD1 no hydrogen 2.824 N/A GLU 214.A N LYS 210.A O no hydrogen 2.922 N/A ASN 215.A N TYR 211.A O no hydrogen 2.950 N/A ASN 215.A N LEU 212.A O no hydrogen 3.319 N/A ASN 215.A ND2 TYR 211.A O no hydrogen 2.864 N/A PHE 219.A N ASN 215.A O no hydrogen 3.016 N/A LEU 220.A N LYS 216.A O no hydrogen 2.890 N/A LYS 221.A N GLU 217.A O no hydrogen 3.153 N/A LEU 222.A N GLU 218.A O no hydrogen 3.103 N/A PHE 223.A N PHE 219.A O no hydrogen 2.796 N/A LYS 227.A N SER 224.A OG no hydrogen 3.218 N/A LYS 227.A NZ GLU 13.A OE1 no hydrogen 2.849 N/A PHE 228.A N SER 224.A O no hydrogen 3.058 N/A ILE 229.A N GLU 225.A O no hydrogen 2.898 N/A SER 230.A N LYS 226.A O no hydrogen 3.150 N/A SER 230.A OG.A LYS 226.A O no hydrogen 3.329 N/A LEU 231.A N LYS 227.A O no hydrogen 3.044 N/A ASP 232.A N PHE 228.A O no hydrogen 2.795 N/A ASP 233.A N ILE 229.A O no hydrogen 2.860 N/A GLY 234.A N SER 230.A O no hydrogen 2.906 N/A TRP 235.A N LEU 231.A O no hydrogen 2.976 N/A TRP 235.A NE1 GLU 208.A OE1 no hydrogen 2.892 N/A SER 236.A N ASP 232.A O no hydrogen 2.957 N/A SER 236.A OG.A ASP 232.A O no hydrogen 3.037 N/A ARG 237.A N ASP 233.A O no hydrogen 2.990 N/A ARG 237.A NH1 ASP 241.A OD2 no hydrogen 2.862 N/A ARG 237.A NH1 GLN 247.A OE1 no hydrogen 2.894 N/A ARG 237.A NH2 GLN 247.A OE1 no hydrogen 2.990 N/A LYS 238.A N GLY 234.A O no hydrogen 3.119 N/A ILE 239.A N TRP 235.A O no hydrogen 2.898 N/A LYS 240.A N SER 236.A O no hydrogen 3.027 N/A LYS 240.A NZ.B SER 236.A OG.B no hydrogen 2.954 N/A ASP 241.A N ARG 237.A O no hydrogen 2.750 N/A SER 242.A N LYS 238.A O no hydrogen 2.877 N/A SER 242.A OG LYS 238.A O no hydrogen 2.780 N/A SER 242.A OG ILE 239.A O no hydrogen 3.145 N/A LYS 243.A N ILE 239.A O no hydrogen 3.096 N/A ARG 244.A N LYS 240.A O no hydrogen 3.336 N/A ARG 244.A NE ASP 241.A OD1 no hydrogen 2.975 N/A ARG 244.A NH2 ASP 160.A OD2 no hydrogen 2.828 N/A ARG 244.A NH2 ASP 241.A OD1 no hydrogen 2.847 N/A LYS 245.A N SER 242.A O no hydrogen 3.115 N/A MET 246.A N ASP 241.A O no hydrogen 2.846 N/A GLN 247.A N ASP 241.A O no hydrogen 3.158 N/A GLN 247.A NE2 TYR 166.A OH no hydrogen 3.218 N/A ARG 248.A N CYS 152.A O no hydrogen 2.931 N/A ARG 248.A NE ASP 196.A OD2 no hydrogen 2.918 N/A ARG 248.A NH1 GLU 178.A OE1 no hydrogen 3.032 N/A ARG 248.A NH2 GLU 178.A OE1 no hydrogen 3.514 N/A ARG 248.A NH2 GLU 178.A OE2 no hydrogen 3.142 N/A ARG 248.A NH2 ASP 196.A OD2 no hydrogen 2.954 N/A TRP 249.A N SER 198.A OG no hydrogen 3.113 N/A TRP 249.A NE1 ASP 119.A OD1 no hydrogen 2.880 N/A GLY 250.A N ASP 150.A O no hydrogen 2.954 N/A TYR 251.A N LYS 195.A O no hydrogen 2.957 N/A PHE 252.A N ILE 148.A O no hydrogen 2.858 N/A LYS 253.A N VAL 193.A O no hydrogen 2.942 N/A LYS 253.A NZ ASP 41.A OD2 no hydrogen 3.165 N/A ALA 254.A N LEU 146.A O no hydrogen 2.938 N/A THR 255.A N LYS 190.A O no hydrogen 2.927 N/A THR 255.A OG1 LYS 190.A O no hydrogen 3.463 N/A THR 255.A OG1 ASN 257.A O no hydrogen 2.716 N/A LYS 256.A N GLY 144.A O no hydrogen 3.447 N/A LYS 256.A NZ ASN 110.A OD1 no hydrogen 3.057 N/A LYS 256.A NZ TYR 137.A O no hydrogen 2.832 N/A LYS 256.A NZ LEU 140.A O no hydrogen 2.909 N/A